#------------------------------------------------------------------------------
#$Date: 2018-09-27 06:13:35 +0200 (jue 27 de sep de 2018) $
#$Revision: 211196 $
#$URL: svn://www.crystallography.net/cod/cif/1/51/05/1510534.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1510534
loop_
_publ_author_name
'Merlo, F.'
'Fornasini, M.L.'
_publ_section_title
;
 Ca7 Au3 and Ca5 Au4, two structures closely related to the Th7 Fe3 and
 Pu5 Rh4 types
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              65
_journal_page_last               70
_journal_paper_doi               10.1016/0022-4596(85)90351-2
_journal_volume                  59
_journal_year                    1985
_chemical_formula_sum            'Au4 Ca5'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 109.16
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.028
_cell_length_b                   8.019
_cell_length_c                   7.727
_cell_volume                     469.882
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            gold_635.cif
_cod_data_source_block           Au4Ca5
_cod_original_cell_volume        469.8823
_cod_database_code               1510534
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z+1/2
-x,-y,-z
x,-y-1/2,z-1/2
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
Ca3 Ca 0.255 0.332 0.252 1 0.0
Au1 Au 0.9884 0.1301 0.3712 1 0.0
Au2 Au 0.4192 0.0329 0.1433 1 0.0
Ca1 Ca 0 0 0 1 0.0
Ca2 Ca 0.692 0.32 0.069 1 0.0
